SCHEMBL30733637

SCHEMBL30733637

CC1=Cc2ccccc2C1c1cccc(C2C(C)=Cc3ccccc32)n1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 1/20 0.35
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
CCR1 P32246 1/20 0.30
CCR8 P51685 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28460906 0.82 ALDH1A1 (0.43) ALDH1A1KDM4ECCR1CCR8SMN1; SMN2
SCHEMBL5477612 0.76 KDM1A (0.44) ALDH1A1KDM4E
SCHEMBL6673270 0.75 GAA (0.35) KDM4E
SCHEMBL6131362 0.74 LMNA (0.42) ALDH1A1KDM4ECCR1CCR8SMN1; SMN2
SCHEMBL7034020 0.73 ALDH1A1 (0.37) TACR1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL21213977 0.72 KDM1A (0.40) ALDH1A1SMN1; SMN2
SCHEMBL7651339 0.71 HSD17B10 (0.39) ALDH1A1TDP1
SCHEMBL7051908 0.71
SCHEMBL7588529 0.71
SCHEMBL6662143 0.70 CYP2A6 (0.38) ALDH1A1KDM4ETDP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111741961-B Catalyst, catalyst system and method of using the same 埃克森美孚化学专利公司 2024-01-12 CN disclosed